2-(propan-2-ylsulfanylmethyl)benzoic acid

Systemtic Name: 2-(propan-2-ylsulfanylmethyl)benzoic acid Openeye Name: 2-(isopropylsulfanylmethyl)benzoic acid CAS Name: 2-[(propan-2-ylthio)methyl]benzoic acid IUPAC Name: 2-(propan-2-ylsulfanylmethyl)benzoic acid Traditional Name: 2-[(isopropylthio)methyl]benzoic acid Formula: C11H14O2S MolecularWeight: 210.29266

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)SCC1=CC=CC=C1C(=O)O

Isomeric SMILES

CC(C)SCC1=CC=CC=C1C(=O)O

InChI

InChI=1S/C11H14O2S/c1-8(2)14-7-9-5-3-4-6-10(9)11(12)13/h3-6,8H,7H2,1-2H3,(H,12,13)